BRD-A62149451-001-01-9
TL;DR: BRD-A62149451-001-01-9 (CAS 1045068-98-1) is a chemical compound with molecular formula C23H22ClN5O2S and molecular weight 467.1183 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[3-[4-(3-chlorophenyl)piperazin-1-yl]-3-oxopropyl]-5-sulfanylidene-1,2-dihydroimidazo[1,2-c]quinazolin-3-one
Also Known As: BRD-A62149451-001-01-9, 2-{3-[4-(3-chlorophenyl)piperazin-1-yl]-3-oxopropyl}-5-sulfanylidene-2H,3H,5H,6H-imidazo[1,2-c]quinazolin-3-one, F0921-6701, 2-[3-[4-(3-chlorophenyl)piperazin-1-yl]-3-oxopropyl]-5-sulfanylidene-1,2-dihydroimidazo[1,2-c]quinazolin-3-one, 2-[3-[4-(3-chlorophenyl)piperazin-1-yl]-3-oxopropyl]-5-sulfanylidene-2,6-dihydroimidazo[1,2-c]quinazolin-3-one
Technical Specifications
| Molecular Formula | C23H22ClN5O2S |
| Molecular Weight | 467.1183 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 100.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 467.1183 Da |
| Heavy Atoms | 32 |
| Complexity | 950.0 |
| SMILES | C1CN(CCN1C2=CC(=CC=C2)Cl)C(=O)CCC3C(=O)N4C(=C5C=CC=CC5=NC4=S)N3 |
| InChIKey | YQRHZBUFILMIEF-UHFFFAOYSA-N |
Chemical Property Profile of BRD-A62149451-001-01-9
Property Insights of BRD-A62149451-001-01-9
The XLogP value of 3.2 indicates that BRD-A62149451-001-01-9 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 100.0 Ų falls within the moderate polarity range, balancing permeability and solubility for BRD-A62149451-001-01-9. Following Lipinski's Rule of Five, BRD-A62149451-001-01-9 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of BRD-A62149451-001-01-9?
The CAS number of BRD-A62149451-001-01-9 is 1045068-98-1.
What is the molecular formula of BRD-A62149451-001-01-9?
The molecular formula of BRD-A62149451-001-01-9 is C23H22ClN5O2S.
What is the molecular weight of BRD-A62149451-001-01-9?
The molecular weight of BRD-A62149451-001-01-9 is 467.1183 g/mol.
Where can I buy BRD-A62149451-001-01-9?
You can request a quote for BRD-A62149451-001-01-9 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for BRD-A62149451-001-01-9?
Yes, CoreyChem provides custom synthesis services for BRD-A62149451-001-01-9 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.